3-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-6-(4-chlorophenyl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-6-(4-chlorophenyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-N-(1,3-benzodioxol-5-ylmethyl)-6-(4-chlorophenyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-N-(1,3-benzodioxol-5-ylmethyl)-6-(4-chlorophenyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-N-(1,3-benzodioxol-5-ylmethyl)-6-(4-chlorophenyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-6-(4-chlorophenyl)-N-piperonyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C22H16ClN3O3S MolecularWeight: 437.89874

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C4=C(S3)N=C(C=C4)C5=CC=C(C=C5)Cl)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C4=C(S3)N=C(C=C4)C5=CC=C(C=C5)Cl)N

InChI

InChI=1S/C22H16ClN3O3S/c23-14-4-2-13(3-5-14)16-7-6-15-19(24)20(30-22(15)26-16)21(27)25-10-12-1-8-17-18(9-12)29-11-28-17/h1-9H,10-11,24H2,(H,25,27)